Docking-based virtual screening and molecular dynamics simulations of quercetin analogs as enoyl-acyl carrier protein reductase (InhA) inhibitors of Mycobacterium …

DAE Pitaloka, DSF Ramadhan, Arfan, L Chaidir… - Scientia …, 2021 - mdpi.com
The emergence of multidrug-resistant Mycobacterium tuberculosis (MTB) has become a
major problem in treating tuberculosis (TB) and shows the need to develop new and efficient …

Promising Ursolic Acid as a Novel Antituberculosis Agent: Current Progress and Challenges

DAE Pitaloka, Y Syaputri, P Nurlilasari… - Drug Design …, 2024 - Taylor & Francis
Tuberculosis (TB) stands as the second most prevalent cause of global human mortality from
infectious diseases. In 2022, the World Health Organization documented an estimated …

Exploring the bioactivity of pentacyclic triterpenoids as potential antimycobacterial nutraceutics: Insights through comparative biomolecular modelling

GF Tolufashe, MM Lawal, KK Govender… - Journal of Molecular …, 2021 - Elsevier
A group of bioactive compounds known as triterpenoids, which are often found in plant
materials, have been tested to possess nutritional and pharmaceutical activity. These plant …

Regulation of mitogen-activated protein kinase signaling pathway and proinflammatory cytokines by ursolic acid in murine macrophages infected with Mycobacterium …

DAE Pitaloka, AM Cooper, AA Artarini… - Infectious disease …, 2020 - pmc.ncbi.nlm.nih.gov
Mycobacterium avium, one of the closest relatives of Mycobacterium tuberculosis (MTB),
offers an advantage in studying MTB because of its tuberculosis-like effect in humans and …

[HTML][HTML] Discovery of potent triterpenoid and limonoid compounds targeting Mycobacterium tuberculosis enoyl acyl carrier protein reductase (InhA): An in silico …

DAE Pitaloka, A Arfan, NM Alfarafisa, L Chaidir… - Informatics in Medicine …, 2023 - Elsevier
Drug resistance remains one of the primary concerns in treating tuberculosis (TB), making it
imperative to find new and effective drug candidates for improved TB treatment. Enoyl acyl …

Alpha-mangostin as an inhibitor of GSK3β in triple-negative breast cancer

C Dewi, A Fristiohady, R Amalia… - Journal of …, 2023 - Taylor & Francis
Triple-negative breast cancer (TNBC) is a breast cancer subtype that does not express the
estrogen receptor, the progesterone receptor, or the human epidermal growth factor receptor …

Design of new quinazoline derivative as EGFR (Epidermal growth factor receptor) inhibitor through molecular docking and dynamics simulation

H Rasyid, B Purwono, HD Pranowo - Indonesian Journal of …, 2021 - journal.ugm.ac.id
Erlotinib, Afatinib, and WZ4002 are quinazoline derivative compounds and classified as first,
second, and third-generation EGFR inhibitor. All inhibitors have been given directly to …

Molecular interactions of Andrographis paniculata Burm. f. Active Compound with Nuclear Receptor (CAR and PXR): An In Silico Assessment Approach

E Sundhani, AE Nugroho, A Nurrochmad… - Indonesian Journal of …, 2022 - journal.ugm.ac.id
The study aims to analyze the potential Herb-Drug Interactions (HDIs) of the chemical
compound in Andrographis paniculate Burm. f. against Constitutive Androstane Receptor …

Anti-Inflammatory Activity of Quts Al-Hindi Extract (Saussurea Lappa) Using Erythrocyte Membrane Stability and Prediction of Its Selectivity for COX-2 and INOS …

IM Sukmawati, M Muchtaridi, A Fristiohady… - Journal of Hunan …, 2023 - jonuns.com
An immune system reaction known as inflammation can damage tissue by rupturing mast
cells, followed by released inflammatory mediators such as nitric oxide (NO) and increased …